SpectraBase Compound ID | 8gVVk9Ed7R4 |
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InChI | InChI=1S/C10H14ClN.ClH/c1-10(2,12)7-8-5-3-4-6-9(8)11;/h3-6H,7,12H2,1-2H3;1H |
InChIKey | QNJJECIHYZJXRL-UHFFFAOYSA-N |
Mol Weight | 220.14 g/mol |
Molecular Formula | C10H15Cl2N |
Exact Mass | 219.058155 g/mol |
SpectraBase Spectrum ID | Khd18T7neqg |
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Name | Clortermine HC l inkbr |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 219.058154887 u |
Formula | C10H15Cl2N |
InChI | InChI=1S/C10H14ClN.ClH/c1-10(2,12)7-8-5-3-4-6-9(8)11;/h3-6H,7,12H2,1-2H3;1H |
InChIKey | QNJJECIHYZJXRL-UHFFFAOYSA-N |
SMILES | NC(CC1=CC=CC=C1Cl)(C)C.Cl |
Spectrum/Structure Validation Score (Raman) | 0.957282 |